IBS-ZINC02401457 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.1940 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 0.0620 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -0.2410 -0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 0.5090 -2.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 0.7500 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 0.6290 -2.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9250 0.9290 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 1.6810 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 3.0540 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 4.3010 -4.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 5.8340 -3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -0.7000 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -1.6500 -2.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 1.4260 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 1.7070 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 3.3080 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4210 3.0270 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 6.0200 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 5.7380 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 6.6660 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 -0.8290 -2.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -1.7000 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 42 43 1 0 0 0 0 M END